Fakultät für Mathematik und Naturwissenschaften

Solid State

Solid-state chemistry using quantum chemistry employs advanced computational methods to analyze the electronic structure and behavior of atoms an

Completed projects

Hexanuclear Copper(I) Complexes


Exploring the bonding and elucidating the character of the excited states of Hexanuclear copper complexes with thiourea derivatives as ligands

Identity crisis of an Oxatellurazole

Structural ambiguity and tendency to engage in different secondary bonding interactions (SBIs) indicate a high uncertainty of the true electronic structure of this compound

Organic dye-sensitized TiO2 interfaces

Theoretical investigations of dye-sensitized solar cells (DSSCs) using linear response time-dependent density functional theory (LR-TDDFT) and electron dynamics

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